Para Sec Butyl Phenol


Chemical Name: Para Sec Butyl Phenol
CAS Number: 99-71-8
Product Number: AG003M0T(AGN-PC-0WAL67)
Synonyms:
MDL No:
Molecular Formula: C10H14O
Molecular Weight: 150.2176

Identification/Properties


Properties
MP:
46-59 °C(lit.)
BP:
241°C at 760 mmHg
Form:
Solid
Refractive Index:
1.5182
Computed Properties
Molecular Weight:
150.221g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
2
Exact Mass:
150.104g/mol
Monoisotopic Mass:
150.104g/mol
Topological Polar Surface Area:
20.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
103
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2430
Hazard Statements:
H314
Precautionary Statements:
P260-P264-P280-P301+P330+P331+P310-P303+P361+P353+P310+P363-P304+P340+P310-P305+P351+P338+P310-P405-P501
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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